Basic information
- CAS
4344-67-6- Standard SMILES
CCCC(CCC)C(=O)Nc1cc(C)ccc1C- InChIKey
NZJOPKCWWACEGM-UHFFFAOYSA-N- Molecular formula
- C16H25NO
- Average molar mass
- 247.38 g/mol
- Monoisotopic mass
- 247.19361442
Names & identifiers
- Preferred name
- 2',5'-Valeroxylidide, 2-propyl-
- IUPAC
- N-(2,5-dimethylphenyl)-2-propylpentanamide
Names & synonyms
4344-67-6Pentanamide, N-(2,5-dimethylphenyl)-2-propyl-2',5'-Valeroxylidide, 2-propyl-2-Propyl-2',5'-valeroxylidideDTXSID30195852RefChem:241063DTXCID70118343N-(2,5-dimethylphenyl)-2-propylpentanamideAO-548/43363510
Database identifiers
- CAS
4344-67-6- PubChem CID
- 199524
- DTXSID
DTXSID30195852
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 245
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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